tert-butyl (1R,6S)-2-ethanoyl-5-phenylselanyl-9-azabicyclo[4.2.1]nonane-9-carboxylate

Systemtic Name: tert-butyl (1R,6S)-2-ethanoyl-5-phenylselanyl-9-azabicyclo[4.2.1]nonane-9-carboxylate Openeye Name: tert-butyl (1R,6S)-2-acetyl-5-phenylselanyl-9-azabicyclo[4.2.1]nonane-9-carboxylate CAS Name: (1R,6S)-2-acetyl-5-(phenylseleno)-9-azabicyclo[4.2.1]nonane-9-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl (1R,6S)-2-acetyl-5-phenylselanyl-9-azabicyclo[4.2.1]nonane-9-carboxylate Traditional Name: (1R,6S)-2-acetyl-5-(phenylseleno)-9-azabicyclo[4.2.1]nonane-9-carboxylic acid tert-butyl ester Formula: C21H29NO3Se MolecularWeight: 422.41986

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1CCC(C2CCC1N2C(=O)OC(C)(C)C)[Se]C3=CC=CC=C3

Isomeric SMILES

CC(=O)C1CCC([C@@H]2CC[C@H]1N2C(=O)OC(C)(C)C)[Se]C3=CC=CC=C3

InChI

InChI=1S/C21H29NO3Se/c1-14(23)16-10-13-19(26-15-8-6-5-7-9-15)18-12-11-17(16)22(18)20(24)25-21(2,3)4/h5-9,16-19H,10-13H2,1-4H3/t16?,17-,18+,19?/m1/s1